T6X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C11 | sing | 1.43Å | 1.43Å | |
| C11 | C10 | sing | 1.53Å | 1.53Å | |
| C12 | C10 | sing | 1.53Å | 1.53Å | |
| C12 | C13 | sing | 1.53Å | 1.50Å | |
| C10 | N6 | sing | 1.46Å | 1.47Å | |
| N6 | C3 | sing | 1.38Å | 1.34Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C1 | N1 | sing | 1.47Å | 1.45Å | |
| C1 | C14 | sing | 1.53Å | 1.52Å | |
| C3 | N2 | sing | 1.33Å | 1.35Å | Aromatic |
| C3 | N3 | doub | 1.32Å | 1.35Å | Aromatic |
| N2 | C2 | doub | 1.33Å | 1.35Å | Aromatic |
| N3 | C4 | sing | 1.33Å | 1.34Å | Aromatic |
| N1 | C2 | sing | 1.38Å | 1.35Å | |
| C2 | C5 | sing | 1.41Å | 1.41Å | Aromatic |
| C4 | C5 | doub | 1.40Å | 1.38Å | Aromatic |
| C4 | N5 | sing | 1.37Å | 1.38Å | Aromatic |
| C5 | N4 | sing | 1.36Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.53Å | 1.50Å | |
| N5 | C7 | sing | 1.47Å | 1.46Å | |
| N5 | C6 | sing | 1.36Å | 1.37Å | Aromatic |
| N4 | C6 | doub | 1.30Å | 1.31Å | Aromatic |
| C7 | C9 | sing | 1.53Å | 1.51Å | |
| C26 | C27 | doub | 1.36Å | 1.36Å | Aromatic |
| C26 | C25 | sing | 1.39Å | 1.40Å | Aromatic |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C27 | C23 | sing | 1.41Å | 1.42Å | Aromatic |
| C25 | C24 | doub | 1.36Å | 1.36Å | Aromatic |
| C17 | C16 | sing | 1.53Å | 1.53Å | |
| C17 | C18 | sing | 1.51Å | 1.51Å | |
| C23 | C18 | sing | 1.41Å | 1.43Å | Aromatic |
| C23 | C22 | doub | 1.42Å | 1.42Å | Aromatic |
| C18 | C19 | doub | 1.36Å | 1.36Å | Aromatic |
| C24 | C22 | sing | 1.41Å | 1.41Å | Aromatic |
| C22 | C21 | sing | 1.41Å | 1.41Å | Aromatic |
| C19 | C20 | sing | 1.39Å | 1.41Å | Aromatic |
| C21 | C20 | doub | 1.36Å | 1.35Å | Aromatic |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H13 | sing | 1.09Å | 1.10Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H14 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C13 | H21 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.09Å | 1.10Å | |
| C13 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H23 | sing | 1.09Å | 1.10Å | |
| C14 | H22 | sing | 1.09Å | 1.10Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| C15 | H25 | sing | 1.09Å | 1.10Å | |
| C16 | H26 | sing | 1.09Å | 1.10Å | |
| C16 | H27 | sing | 1.09Å | 1.10Å | |
| C17 | H28 | sing | 1.09Å | 1.10Å | |
| C17 | H29 | sing | 1.09Å | 1.10Å | |
| C19 | H30 | sing | 1.08Å | 1.08Å | |
| C20 | H31 | sing | 1.08Å | 1.08Å | |
| C21 | H32 | sing | 1.08Å | 1.08Å | |
| C24 | H33 | sing | 1.08Å | 1.08Å | |
| C25 | H34 | sing | 1.08Å | 1.08Å | |
| C26 | H35 | sing | 1.08Å | 1.08Å | |
| C27 | H36 | sing | 1.08Å | 1.08Å | |
| C6 | H4 | sing | 1.08Å | 1.08Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H11 | sing | 1.09Å | 1.10Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| N1 | H3 | sing | 0.97Å | 1.00Å | |
| N6 | H12 | sing | 0.97Å | 1.00Å | |
| O1 | H16 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C11 | C10 | 111.7° | 109.5° |
| O1 | C11 | H15 | 108.9° | 109.4° |
| O1 | C11 | H14 | 108.9° | 109.5° |
| C11 | O1 | H16 | 109.5° | 114.0° |
| C11 | C10 | C12 | 113.9° | 109.4° |
| C11 | C10 | N6 | 108.9° | 109.5° |
| C11 | C10 | H13 | 108.0° | 109.5° |
| C10 | C11 | H15 | 108.9° | 109.5° |
| C10 | C11 | H14 | 108.9° | 109.5° |
| C10 | C12 | C13 | 115.0° | 109.5° |
| C12 | C10 | N6 | 109.3° | 109.5° |
| C12 | C10 | H13 | 107.9° | 109.5° |
| C10 | C12 | H18 | 108.0° | 109.5° |
| C10 | C12 | H17 | 108.0° | 109.5° |
| C13 | C12 | H18 | 108.1° | 109.5° |
| C13 | C12 | H17 | 108.1° | 109.5° |
| C12 | C13 | H21 | 109.5° | 109.5° |
| C12 | C13 | H20 | 109.5° | 109.4° |
| C12 | C13 | H19 | 109.5° | 109.4° |
| C10 | N6 | C3 | 122.7° | 120.0° |
| N6 | C10 | H13 | 108.8° | 109.5° |
| C10 | N6 | H12 | 106.1° | 120.0° |
| N6 | C3 | N2 | 116.9° | 118.9° |
| N6 | C3 | N3 | 117.9° | 118.9° |
| C3 | N6 | H12 | 106.1° | 120.0° |
| C8 | C7 | N5 | 112.1° | 109.5° |
| C8 | C7 | C9 | 112.4° | 109.5° |
| C8 | C7 | H5 | 106.5° | 109.5° |
| C7 | C8 | H7 | 109.5° | 109.5° |
| C7 | C8 | H6 | 109.5° | 109.5° |
| C7 | C8 | H8 | 109.5° | 109.5° |
| N1 | C1 | C14 | 111.1° | 109.4° |
| C1 | N1 | C2 | 123.3° | 120.0° |
| N1 | C1 | H2 | 109.1° | 109.5° |
| N1 | C1 | H1 | 109.0° | 109.4° |
| C1 | N1 | H3 | 105.9° | 120.0° |
| C1 | C14 | C15 | 114.4° | 109.5° |
| C14 | C1 | H2 | 109.1° | 109.5° |
| C14 | C1 | H1 | 109.1° | 109.5° |
| C1 | C14 | H23 | 108.2° | 109.5° |
| C1 | C14 | H22 | 108.2° | 109.5° |
| N2 | C3 | N3 | 125.1° | 122.2° |
| C3 | N2 | C2 | 120.3° | 121.1° |
| C3 | N3 | C4 | 113.2° | 120.6° |
| N2 | C2 | N1 | 119.2° | 120.7° |
| N2 | C2 | C5 | 118.7° | 118.6° |
| N3 | C4 | C5 | 126.9° | 119.1° |
| N3 | C4 | N5 | 127.2° | 134.9° |
| N1 | C2 | C5 | 122.1° | 120.7° |
| C2 | N1 | H3 | 105.9° | 120.0° |
| C2 | C5 | C4 | 115.7° | 118.3° |
| C2 | C5 | N4 | 133.5° | 134.6° |
| C5 | C4 | N5 | 105.8° | 106.0° |
| C4 | C5 | N4 | 110.8° | 107.1° |
| C4 | N5 | C7 | 130.0° | 126.3° |
| C4 | N5 | C6 | 105.8° | 107.4° |
| C5 | N4 | C6 | 103.5° | 109.4° |
| C14 | C15 | C16 | 115.5° | 109.5° |
| C15 | C14 | H23 | 108.2° | 109.5° |
| C15 | C14 | H22 | 108.2° | 109.5° |
| C14 | C15 | H24 | 107.9° | 109.5° |
| C14 | C15 | H25 | 107.9° | 109.5° |
| C7 | N5 | C6 | 124.3° | 126.3° |
| N5 | C7 | C9 | 111.5° | 109.4° |
| N5 | C7 | H5 | 107.3° | 109.5° |
| N5 | C6 | N4 | 114.1° | 110.0° |
| N5 | C6 | H4 | 122.9° | 125.0° |
| N4 | C6 | H4 | 122.9° | 125.0° |
| C9 | C7 | H5 | 106.7° | 109.4° |
| C7 | C9 | H11 | 109.5° | 109.5° |
| C7 | C9 | H10 | 109.5° | 109.5° |
| C7 | C9 | H9 | 109.5° | 109.5° |
| C27 | C26 | C25 | 120.5° | 121.0° |
| C26 | C27 | C23 | 121.6° | 119.6° |
| C27 | C26 | H35 | 119.7° | 119.5° |
| C26 | C27 | H36 | 119.3° | 120.1° |
| C26 | C25 | C24 | 120.2° | 121.0° |
| C26 | C25 | H34 | 119.9° | 119.6° |
| C25 | C26 | H35 | 119.8° | 119.5° |
| C15 | C16 | C17 | 113.1° | 109.4° |
| C16 | C15 | H24 | 108.0° | 109.5° |
| C16 | C15 | H25 | 107.9° | 109.4° |
| C15 | C16 | H26 | 108.6° | 109.5° |
| C15 | C16 | H27 | 108.6° | 109.4° |
| C27 | C23 | C18 | 123.3° | 121.3° |
| C27 | C23 | C22 | 117.3° | 119.4° |
| C23 | C27 | H36 | 119.2° | 120.2° |
| C25 | C24 | C22 | 120.8° | 119.7° |
| C25 | C24 | H33 | 119.6° | 120.2° |
| C24 | C25 | H34 | 119.9° | 119.5° |
| C16 | C17 | C18 | 116.3° | 109.5° |
| C17 | C16 | H26 | 108.6° | 109.5° |
| C17 | C16 | H27 | 108.6° | 109.5° |
| C16 | C17 | H28 | 107.7° | 109.5° |
| C16 | C17 | H29 | 107.7° | 109.5° |
| C17 | C18 | C23 | 119.4° | 120.2° |
| C17 | C18 | C19 | 121.8° | 120.1° |
| C18 | C17 | H28 | 107.7° | 109.4° |
| C18 | C17 | H29 | 107.7° | 109.5° |
| C18 | C23 | C22 | 119.4° | 119.4° |
| C23 | C18 | C19 | 118.8° | 119.7° |
| C23 | C22 | C24 | 119.6° | 119.4° |
| C23 | C22 | C21 | 119.0° | 119.3° |
| C18 | C19 | C20 | 121.9° | 121.0° |
| C18 | C19 | H30 | 119.0° | 119.5° |
| C24 | C22 | C21 | 121.4° | 121.3° |
| C22 | C24 | H33 | 119.6° | 120.2° |
| C22 | C21 | C20 | 120.8° | 119.6° |
| C22 | C21 | H32 | 119.6° | 120.2° |
| C19 | C20 | C21 | 120.2° | 121.0° |
| C20 | C19 | H30 | 119.0° | 119.5° |
| C19 | C20 | H31 | 119.9° | 119.5° |
| C21 | C20 | H31 | 119.9° | 119.5° |
| C20 | C21 | H32 | 119.6° | 120.2° |
| H2 | C1 | H1 | 109.5° | 109.5° |
| H15 | C11 | H14 | 109.5° | 109.5° |
| H18 | C12 | H17 | 109.5° | 109.5° |
| H21 | C13 | H20 | 109.5° | 109.5° |
| H21 | C13 | H19 | 109.4° | 109.5° |
| H20 | C13 | H19 | 109.5° | 109.5° |
| H23 | C14 | H22 | 109.5° | 109.4° |
| H24 | C15 | H25 | 109.5° | 109.5° |
| H26 | C16 | H27 | 109.4° | 109.5° |
| H28 | C17 | H29 | 109.5° | 109.5° |
| H7 | C8 | H6 | 109.5° | 109.4° |
| H7 | C8 | H8 | 109.4° | 109.5° |
| H6 | C8 | H8 | 109.5° | 109.4° |
| H11 | C9 | H10 | 109.4° | 109.5° |
| H11 | C9 | H9 | 109.5° | 109.4° |
| H10 | C9 | H9 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C11 | C10 | H15 | 120.4° | 120.0° |
| O1 | C11 | C10 | H14 | 120.4° | 120.0° |
| O1 | C11 | C10 | C12 | 69.0° | 55.0° |
| O1 | C11 | C10 | N6 | 168.8° | 65.0° |
| O1 | C11 | C10 | H13 | 50.9° | 174.9° |
| O1 | C11 | H15 | H14 | 119.0° | 120.0° |
| C11 | C10 | C12 | N6 | 122.0° | 120.0° |
| C11 | C10 | C12 | H13 | 119.9° | 120.0° |
| C11 | C10 | C12 | C13 | 72.3° | 175.0° |
| C11 | C10 | N6 | H13 | 117.4° | 120.0° |
| C11 | C10 | N6 | C3 | 58.3° | 85.0° |
| C10 | C11 | H15 | H14 | 118.9° | 120.0° |
| C11 | C10 | C12 | H18 | 166.8° | 55.0° |
| C11 | C10 | C12 | H17 | 48.5° | 65.0° |
| C11 | C10 | N6 | H12 | 179.9° | 95.0° |
| C10 | C11 | O1 | H16 | 180.0° | 179.9° |
| C10 | C12 | C13 | H18 | 120.8° | 120.0° |
| C10 | C12 | C13 | H17 | 120.8° | 120.0° |
| C12 | C10 | N6 | H13 | 117.6° | 120.0° |
| C12 | C10 | N6 | C3 | 176.7° | 155.0° |
| C12 | C10 | C11 | H15 | 51.4° | 65.0° |
| C12 | C10 | C11 | H14 | 170.6° | 175.0° |
| C10 | C12 | H18 | H17 | 117.4° | 120.0° |
| C10 | C12 | C13 | H21 | 180.0° | 60.0° |
| C10 | C12 | C13 | H20 | 60.0° | 60.0° |
| C10 | C12 | C13 | H19 | 60.0° | 180.0° |
| C12 | C10 | N6 | H12 | 54.9° | 25.0° |
| C13 | C12 | C10 | N6 | 49.7° | 65.0° |
| C13 | C12 | C10 | H13 | 167.8° | 55.0° |
| C13 | C12 | H18 | H17 | 117.5° | 120.0° |
| C12 | C13 | H21 | H20 | 120.0° | 119.9° |
| C12 | C13 | H21 | H19 | 120.0° | 120.0° |
| C12 | C13 | H20 | H19 | 120.0° | 120.0° |
| C10 | N6 | C3 | H12 | 121.8° | 180.0° |
| C10 | N6 | C3 | N2 | 91.9° | 0.0° |
| C10 | N6 | C3 | N3 | 85.9° | 179.9° |
| N6 | C10 | C11 | H15 | 70.8° | 175.0° |
| N6 | C10 | C11 | H14 | 48.4° | 55.0° |
| N6 | C10 | C12 | H18 | 71.2° | 175.0° |
| N6 | C10 | C12 | H17 | 170.5° | 55.0° |
| N6 | C3 | N2 | N3 | 177.6° | 179.9° |
| N6 | C3 | N2 | C2 | 179.3° | 179.9° |
| N6 | C3 | N3 | C4 | 179.3° | 179.7° |
| C3 | N6 | C10 | H13 | 59.1° | 35.0° |
| C8 | C7 | N5 | C4 | 76.9° | 120.0° |
| C8 | C7 | N5 | C9 | 127.0° | 120.0° |
| C8 | C7 | N5 | H5 | 116.5° | 120.1° |
| C8 | C7 | N5 | C6 | 103.7° | 60.0° |
| C8 | C7 | C9 | H5 | 116.4° | 120.0° |
| C7 | C8 | H7 | H6 | 120.0° | 120.0° |
| C7 | C8 | H7 | H8 | 120.0° | 120.0° |
| C7 | C8 | H6 | H8 | 120.0° | 120.1° |
| C8 | C7 | C9 | H11 | 180.0° | 180.0° |
| C8 | C7 | C9 | H10 | 60.0° | 60.0° |
| C8 | C7 | C9 | H9 | 60.0° | 60.0° |
| N1 | C1 | C14 | H2 | 120.3° | 120.0° |
| N1 | C1 | C14 | H1 | 120.2° | 119.9° |
| C1 | N1 | C2 | N2 | 2.2° | 0.4° |
| C1 | N1 | C2 | H3 | 121.9° | 179.9° |
| C1 | N1 | C2 | C5 | 176.6° | 180.0° |
| N1 | C1 | C14 | C15 | 51.9° | 180.0° |
| N1 | C1 | H2 | H1 | 119.3° | 120.0° |
| N1 | C1 | C14 | H23 | 68.8° | 60.0° |
| N1 | C1 | C14 | H22 | 172.6° | 59.9° |
| C14 | C1 | N1 | C2 | 127.1° | 180.0° |
| C1 | C14 | C15 | H23 | 120.7° | 120.0° |
| C1 | C14 | C15 | H22 | 120.7° | 120.0° |
| C1 | C14 | C15 | C16 | 171.8° | 180.0° |
| C14 | C1 | H2 | H1 | 119.2° | 120.0° |
| C1 | C14 | H23 | H22 | 117.7° | 120.0° |
| C1 | C14 | C15 | H24 | 67.3° | 60.0° |
| C1 | C14 | C15 | H25 | 50.9° | 60.0° |
| C14 | C1 | N1 | H3 | 111.0° | 0.1° |
| N2 | C3 | N3 | C4 | 1.7° | 0.2° |
| C3 | N2 | C2 | N1 | 179.7° | 179.7° |
| C3 | N2 | C2 | C5 | 0.9° | 0.0° |
| N2 | C3 | N6 | H12 | 29.9° | 180.0° |
| N3 | C3 | N2 | C2 | 1.7° | 0.0° |
| C3 | N3 | C4 | C5 | 1.1° | 0.4° |
| C3 | N3 | C4 | N5 | 179.8° | 179.8° |
| N3 | C3 | N6 | H12 | 152.3° | 0.1° |
| N2 | C2 | N1 | C5 | 178.8° | 179.6° |
| N2 | C2 | C5 | C4 | 0.3° | 0.3° |
| N2 | C2 | C5 | N4 | 179.9° | 179.7° |
| N2 | C2 | N1 | H3 | 124.1° | 179.8° |
| N3 | C4 | C5 | C2 | 0.4° | 0.5° |
| N3 | C4 | C5 | N5 | 179.0° | 179.5° |
| N3 | C4 | C5 | N4 | 179.7° | 179.5° |
| N3 | C4 | N5 | C7 | 0.8° | 0.6° |
| N3 | C4 | N5 | C6 | 179.7° | 179.4° |
| N1 | C2 | C5 | C4 | 179.1° | 179.9° |
| N1 | C2 | C5 | N4 | 1.1° | 0.1° |
| C2 | N1 | C1 | H2 | 112.7° | 59.9° |
| C2 | N1 | C1 | H1 | 6.8° | 60.1° |
| C2 | C5 | C4 | N4 | 179.9° | 180.0° |
| C2 | C5 | C4 | N5 | 179.4° | 180.0° |
| C2 | C5 | N4 | C6 | 179.8° | 179.9° |
| C5 | C2 | N1 | H3 | 54.7° | 0.1° |
| C5 | C4 | N5 | C7 | 179.8° | 180.0° |
| C5 | C4 | N5 | C6 | 0.8° | 0.0° |
| C4 | C5 | N4 | C6 | 0.4° | 0.0° |
| N5 | C4 | C5 | N4 | 0.7° | 0.0° |
| C4 | N5 | C7 | C6 | 179.4° | 180.0° |
| C4 | N5 | C6 | N4 | 0.6° | 0.0° |
| C4 | N5 | C7 | C9 | 50.1° | 120.0° |
| C4 | N5 | C6 | H4 | 179.4° | 179.9° |
| C4 | N5 | C7 | H5 | 166.6° | 0.1° |
| C5 | N4 | C6 | N5 | 0.1° | 0.0° |
| C5 | N4 | C6 | H4 | 179.9° | 179.9° |
| C14 | C15 | C16 | H24 | 120.9° | 120.1° |
| C14 | C15 | C16 | H25 | 120.9° | 120.0° |
| C14 | C15 | C16 | C17 | 55.8° | 180.0° |
| C15 | C14 | C1 | H2 | 172.2° | 60.0° |
| C15 | C14 | C1 | H1 | 68.3° | 60.0° |
| C15 | C14 | H23 | H22 | 117.7° | 120.0° |
| C14 | C15 | H24 | H25 | 117.2° | 120.0° |
| C14 | C15 | C16 | H26 | 176.3° | 60.0° |
| C14 | C15 | C16 | H27 | 64.8° | 60.0° |
| C7 | N5 | C6 | N4 | 179.9° | 180.0° |
| N5 | C7 | C9 | H5 | 116.8° | 120.0° |
| C7 | N5 | C6 | H4 | 0.1° | 0.1° |
| N5 | C7 | C8 | H7 | 180.0° | 180.0° |
| N5 | C7 | C8 | H6 | 60.0° | 60.0° |
| N5 | C7 | C8 | H8 | 60.0° | 60.0° |
| N5 | C7 | C9 | H11 | 53.2° | 60.0° |
| N5 | C7 | C9 | H10 | 66.8° | 180.0° |
| N5 | C7 | C9 | H9 | 173.2° | 60.0° |
| N5 | C6 | N4 | H4 | 180.0° | 179.9° |
| C6 | N5 | C7 | C9 | 129.2° | 60.0° |
| C6 | N5 | C7 | H5 | 12.8° | 180.0° |
| C9 | C7 | C8 | H7 | 53.5° | 60.0° |
| C9 | C7 | C8 | H6 | 66.5° | 180.0° |
| C9 | C7 | C8 | H8 | 173.5° | 60.0° |
| C7 | C9 | H11 | H10 | 120.0° | 120.0° |
| C7 | C9 | H11 | H9 | 120.0° | 120.0° |
| C7 | C9 | H10 | H9 | 120.0° | 120.0° |
| C27 | C26 | C25 | H35 | 180.0° | 179.2° |
| C26 | C27 | C23 | H36 | 180.0° | 179.3° |
| C27 | C26 | C25 | C24 | 0.1° | 0.6° |
| C26 | C27 | C23 | C18 | 179.9° | 179.2° |
| C26 | C27 | C23 | C22 | 0.1° | 0.5° |
| C27 | C26 | C25 | H34 | 179.9° | 179.5° |
| C25 | C26 | C27 | C23 | 0.0° | 0.8° |
| C26 | C25 | C24 | H34 | 180.0° | 179.9° |
| C26 | C25 | C24 | C22 | 0.1° | 0.1° |
| C26 | C25 | C24 | H33 | 179.9° | 180.0° |
| C25 | C26 | C27 | H36 | 180.0° | 179.9° |
| C15 | C16 | C17 | H26 | 120.6° | 120.0° |
| C15 | C16 | C17 | H27 | 120.5° | 120.0° |
| C15 | C16 | C17 | C18 | 116.1° | 180.0° |
| C16 | C15 | C14 | H23 | 51.1° | 60.0° |
| C16 | C15 | C14 | H22 | 67.4° | 60.0° |
| C16 | C15 | H24 | H25 | 117.2° | 120.0° |
| C15 | C16 | H26 | H27 | 118.4° | 120.0° |
| C15 | C16 | C17 | H28 | 122.9° | 60.0° |
| C15 | C16 | C17 | H29 | 4.9° | 60.0° |
| C27 | C23 | C18 | C17 | 0.2° | 0.0° |
| C27 | C23 | C18 | C22 | 180.0° | 179.7° |
| C27 | C23 | C18 | C19 | 180.0° | 179.7° |
| C27 | C23 | C22 | C24 | 0.0° | 0.1° |
| C27 | C23 | C22 | C21 | 180.0° | 179.8° |
| C23 | C27 | C26 | H35 | 180.0° | 180.0° |
| C25 | C24 | C22 | C23 | 0.0° | 0.1° |
| C25 | C24 | C22 | H33 | 180.0° | 179.9° |
| C25 | C24 | C22 | C21 | 179.9° | 180.0° |
| C24 | C25 | C26 | H35 | 179.9° | 179.8° |
| C16 | C17 | C18 | H28 | 121.0° | 120.0° |
| C16 | C17 | C18 | H29 | 121.0° | 120.0° |
| C16 | C17 | C18 | C23 | 96.7° | 84.7° |
| C16 | C17 | C18 | C19 | 83.1° | 95.0° |
| C17 | C16 | C15 | H24 | 65.1° | 60.0° |
| C17 | C16 | C15 | H25 | 176.6° | 60.0° |
| C17 | C16 | H26 | H27 | 118.4° | 120.0° |
| C16 | C17 | H28 | H29 | 116.9° | 120.0° |
| C17 | C18 | C23 | C19 | 179.8° | 179.7° |
| C17 | C18 | C23 | C22 | 179.8° | 179.8° |
| C17 | C18 | C19 | C20 | 179.7° | 180.0° |
| C18 | C17 | C16 | H26 | 4.4° | 60.0° |
| C18 | C17 | C16 | H27 | 123.3° | 60.0° |
| C18 | C17 | H28 | H29 | 116.9° | 120.0° |
| C17 | C18 | C19 | H30 | 0.3° | 0.0° |
| C18 | C23 | C22 | C24 | 179.9° | 179.7° |
| C18 | C23 | C22 | C21 | 0.0° | 0.5° |
| C23 | C18 | C19 | C20 | 0.1° | 0.3° |
| C23 | C18 | C17 | H28 | 142.3° | 35.3° |
| C23 | C18 | C17 | H29 | 24.3° | 155.3° |
| C23 | C18 | C19 | H30 | 179.9° | 179.7° |
| C18 | C23 | C27 | H36 | 0.1° | 0.1° |
| C22 | C23 | C18 | C19 | 0.0° | 0.5° |
| C23 | C22 | C24 | C21 | 180.0° | 179.9° |
| C23 | C22 | C21 | C20 | 0.1° | 0.2° |
| C23 | C22 | C21 | H32 | 179.9° | 179.8° |
| C23 | C22 | C24 | H33 | 179.9° | 179.8° |
| C22 | C23 | C27 | H36 | 179.9° | 179.8° |
| C18 | C19 | C20 | H30 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.1° | 0.0° |
| C19 | C18 | C17 | H28 | 37.9° | 145.0° |
| C19 | C18 | C17 | H29 | 155.9° | 25.0° |
| C18 | C19 | C20 | H31 | 179.9° | 180.0° |
| C24 | C22 | C21 | C20 | 179.9° | 180.0° |
| C24 | C22 | C21 | H32 | 0.1° | 0.1° |
| C22 | C24 | C25 | H34 | 179.9° | 180.0° |
| C22 | C21 | C20 | C19 | 0.1° | 0.1° |
| C22 | C21 | C20 | H32 | 180.0° | 179.9° |
| C22 | C21 | C20 | H31 | 179.9° | 180.0° |
| C21 | C22 | C24 | H33 | 0.1° | 0.1° |
| C19 | C20 | C21 | H31 | 180.0° | 180.0° |
| C19 | C20 | C21 | H32 | 179.9° | 180.0° |
| C21 | C20 | C19 | H30 | 179.9° | 180.0° |
| H2 | C1 | C14 | H23 | 51.4° | 60.0° |
| H2 | C1 | C14 | H22 | 67.1° | 180.0° |
| H2 | C1 | N1 | H3 | 9.2° | 119.9° |
| H1 | C1 | C14 | H23 | 170.9° | 180.0° |
| H1 | C1 | C14 | H22 | 52.4° | 60.0° |
| H1 | C1 | N1 | H3 | 128.8° | 120.0° |
| H13 | C10 | C11 | H15 | 171.2° | 55.0° |
| H13 | C10 | C11 | H14 | 69.5° | 65.0° |
| H13 | C10 | C12 | H18 | 46.9° | 65.0° |
| H13 | C10 | C12 | H17 | 71.4° | 175.0° |
| H13 | C10 | N6 | H12 | 62.7° | 145.0° |
| H15 | C11 | O1 | H16 | 59.7° | 60.1° |
| H14 | C11 | O1 | H16 | 59.6° | 59.9° |
| H18 | C12 | C13 | H21 | 59.2° | 180.0° |
| H18 | C12 | C13 | H20 | 179.2° | 60.0° |
| H18 | C12 | C13 | H19 | 60.8° | 60.0° |
| H17 | C12 | C13 | H21 | 59.2° | 60.0° |
| H17 | C12 | C13 | H20 | 60.8° | 180.0° |
| H17 | C12 | C13 | H19 | 179.2° | 60.0° |
| H21 | C13 | H20 | H19 | 120.0° | 120.1° |
| H23 | C14 | C15 | H24 | 172.0° | 180.0° |
| H23 | C14 | C15 | H25 | 69.8° | 60.0° |
| H22 | C14 | C15 | H24 | 53.5° | 60.0° |
| H22 | C14 | C15 | H25 | 171.7° | 180.0° |
| H24 | C15 | C16 | H26 | 55.4° | 180.0° |
| H24 | C15 | C16 | H27 | 174.3° | 60.0° |
| H25 | C15 | C16 | H26 | 62.8° | 60.0° |
| H25 | C15 | C16 | H27 | 56.1° | 180.0° |
| H26 | C16 | C17 | H28 | 116.6° | 180.0° |
| H26 | C16 | C17 | H29 | 125.4° | 60.0° |
| H27 | C16 | C17 | H28 | 2.3° | 59.9° |
| H27 | C16 | C17 | H29 | 115.7° | 180.0° |
| H30 | C19 | C20 | H31 | 0.1° | 0.0° |
| H31 | C20 | C21 | H32 | 0.1° | 0.0° |
| H33 | C24 | C25 | H34 | 0.1° | 0.0° |
| H34 | C25 | C26 | H35 | 0.1° | 0.3° |
| H35 | C26 | C27 | H36 | 0.0° | 0.7° |
| H5 | C7 | C8 | H7 | 63.0° | 60.0° |
| H5 | C7 | C8 | H6 | 177.0° | 60.0° |
| H5 | C7 | C8 | H8 | 57.0° | 180.0° |
| H5 | C7 | C9 | H11 | 63.6° | 60.0° |
| H5 | C7 | C9 | H10 | 176.4° | 60.0° |
| H5 | C7 | C9 | H9 | 56.4° | 180.0° |
| H7 | C8 | H6 | H8 | 119.9° | 119.9° |
| H11 | C9 | H10 | H9 | 120.0° | 120.0° |
